BDBM50030912 (8S,9S,12S,14S,16R)-19-(azetidin-1-yl)-8,14-dimethoxy-4,10,12,16-tetramethyl-3,13,20,22-tetraoxo-2-azabicyclo[16.3.1]docosa-1(21),4,6,10,18-pentaen-9-yl carbamate::CHEMBL341342::Carbamic acid (4E,6Z,10E)-(8S,9S,12S,14S,16R)-19-azetidin-1-yl-8,14-dimethoxy-4,10,12,16-tetramethyl-3,13,20,22-tetraoxo-2-aza-bicyclo[16.3.1]docosa-1(21),4,6,10,18-pentaen-9-yl ester

SMILES CO[C@H]1CC(C)=Cc2c(O)c(NC(=O)C(C)=CC=C[C@H](OC)[C@@H](OC(N)=O)\C(C)=C\[C@H](C)C1=O)cc(O)c2N1CCC1

InChI Key InChIKey=YOXATWXXCAGEST-UHFFFAOYSA-N

Data  1 Kd

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50030912   

TargetHeat shock protein HSP 90-beta(Human)
Kosan Biosciences

Curated by ChEMBL
LigandPNGBDBM50030912(Carbamic acid (4E,6Z,10E)-(8S,9S,12S,14S,16R)-19-a...)
Affinity DataKd:  6.40E+3nMAssay Description:Binding affinity to human recombinant HSP90More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/23/2012
Entry Details Article
PubMed